(3S)-6,7-dimethoxy-3-[(4-phenyldiazenylphenyl)amino]-3H-2-benzofuran-1-one

Systemtic Name: (3S)-6,7-dimethoxy-3-[(4-phenyldiazenylphenyl)amino]-3H-2-benzofuran-1-one Openeye Name: (3S)-6,7-dimethoxy-3-(4-phenylazoanilino)-3H-isobenzofuran-1-one CAS Name: (3S)-6,7-dimethoxy-3-(4-phenyldiazenylanilino)-3H-isobenzofuran-1-one IUPAC Name: (3S)-6,7-dimethoxy-3-(4-phenyldiazenylanilino)-3H-2-benzofuran-1-one Traditional Name: (3S)-6,7-dimethoxy-3-(4-phenylazoanilino)phthalide Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)[C@H](OC2=O)NC3=CC=C(C=C3)N=NC4=CC=CC=C4)OC

InChI

InChI=1S/C22H19N3O4/c1-27-18-13-12-17-19(20(18)28-2)22(26)29-21(17)23-14-8-10-16(11-9-14)25-24-15-6-4-3-5-7-15/h3-13,21,23H,1-2H3/t21-/m0/s1